2-[4-bromanyl-1-propan-2-yl-5-(2,3,6-trimethylphenyl)carbonyl-pyrrol-2-yl]ethanoic acid

Systemtic Name: 2-[4-bromanyl-1-propan-2-yl-5-(2,3,6-trimethylphenyl)carbonyl-pyrrol-2-yl]ethanoic acid Openeye Name: 2-[4-bromo-1-isopropyl-5-(2,3,6-trimethylbenzoyl)pyrrol-2-yl]acetic acid CAS Name: 2-[4-bromo-5-[oxo-(2,3,6-trimethylphenyl)methyl]-1-propan-2-yl-2-pyrrolyl]acetic acid IUPAC Name: 2-[4-bromo-1-propan-2-yl-5-(2,3,6-trimethylbenzoyl)pyrrol-2-yl]acetic acid Traditional Name: 2-[4-bromo-1-isopropyl-5-(2,3,6-trimethylbenzoyl)pyrrol-2-yl]acetic acid Formula: C19H22BrNO3 MolecularWeight: 392.28688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)C(=O)C2=C(C=C(N2C(C)C)CC(=O)O)Br)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)C(=O)C2=C(C=C(N2C(C)C)CC(=O)O)Br)C

InChI

InChI=1S/C19H22BrNO3/c1-10(2)21-14(9-16(22)23)8-15(20)18(21)19(24)17-12(4)7-6-11(3)13(17)5/h6-8,10H,9H2,1-5H3,(H,22,23)